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Details

Stereochemistry ACHIRAL
Molecular Formula C17H16N4O3
Molecular Weight 324.3339
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-ALANINE, N-((1-METHYL-1H-BENZIMIDAZOL-5-YL)CARBONYL)-N-2-PYRIDINYL-

SMILES

CN1C=NC2=C1C=CC(=C2)C(=O)N(CCC(O)=O)C3=NC=CC=C3

InChI

InChIKey=JGHAOUYTBYRFRI-UHFFFAOYSA-N
InChI=1S/C17H16N4O3/c1-20-11-19-13-10-12(5-6-14(13)20)17(24)21(9-7-16(22)23)15-4-2-3-8-18-15/h2-6,8,10-11H,7,9H2,1H3,(H,22,23)

HIDE SMILES / InChI

Molecular Formula C17H16N4O3
Molecular Weight 324.3339
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:30:16 GMT 2023
Edited
by admin
on Sat Dec 16 16:30:16 GMT 2023
Record UNII
5N73E3P7ZE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.BETA.-ALANINE, N-((1-METHYL-1H-BENZIMIDAZOL-5-YL)CARBONYL)-N-2-PYRIDINYL-
Systematic Name English
DABIGATRAN METABOLITE M325
Common Name English
CD00000338
Common Name English
Code System Code Type Description
FDA UNII
5N73E3P7ZE
Created by admin on Sat Dec 16 16:30:17 GMT 2023 , Edited by admin on Sat Dec 16 16:30:17 GMT 2023
PRIMARY
CAS
1015167-28-8
Created by admin on Sat Dec 16 16:30:17 GMT 2023 , Edited by admin on Sat Dec 16 16:30:17 GMT 2023
PRIMARY
PUBCHEM
156596423
Created by admin on Sat Dec 16 16:30:17 GMT 2023 , Edited by admin on Sat Dec 16 16:30:17 GMT 2023
PRIMARY
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